2-[2,3-bis(2-sulfonatophenyl)cyclohexa-1,3-dien-1-yl]benzenesulfonate; manganese(3+)

Systemtic Name: 2-[2,3-bis(2-sulfonatophenyl)cyclohexa-1,3-dien-1-yl]benzenesulfonate; manganese(3+) Openeye Name: manganic 2-[2,3-bis(2-sulfonatophenyl)cyclohexa-1,3-dien-1-yl]benzenesulfonate CAS Name: 2-[2,3-bis(2-sulfonatophenyl)-1-cyclohexa-1,3-dienyl]benzenesulfonate; manganese(3+) IUPAC Name: 2-[2,3-bis(2-sulfonatophenyl)cyclohexa-1,3-dien-1-yl]benzenesulfonate; manganese(3+) Traditional Name: manganic 2-[2,3-bis(2-sulfonatophenyl)cyclohexa-1,3-dien-1-yl]besylate Formula: C24H17MnO9S3 MolecularWeight: 600.519429

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=C1)C2=CC=CC=C2S(=O)(=O)[O-])C3=CC=CC=C3S(=O)(=O)[O-])C4=CC=CC=C4S(=O)(=O)[O-].[Mn+3]

Isomeric SMILES

C1CC(=C(C(=C1)C2=CC=CC=C2S(=O)(=O)[O-])C3=CC=CC=C3S(=O)(=O)[O-])C4=CC=CC=C4S(=O)(=O)[O-].[Mn+3]

InChI

InChI=1S/C24H20O9S3.Mn/c25-34(26,27)21-13-4-1-8-16(21)18-11-7-12-19(17-9-2-5-14-22(17)35(28,29)30)24(18)20-10-3-6-15-23(20)36(31,32)33;/h1-6,8-11,13-15H,7,12H2,(H,25,26,27)(H,28,29,30)(H,31,32,33);/q;+3/p-3